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TX-1918

CAT: 0804-HY-112393-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-112393-02Size:5 mg
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Description
TX-1918 is an inhibitor for eukaryotic elongation factor 2 kinase (eEF2-K) and Src kinase with IC50 of 0.44 and 4.4 μM, respectively. TX-1918 exhibits cytotoxicity in cell HepG2 and HCT116, with IC50 of 2.07 and 230 μM, respectively. TX-1918 inhibits the C-terminal domain of HIV-1 CA (CA CTD) (IC50 =3.81 μM), and inhibits the viral replication (IC50 =15.16 μM) [1][2].
CAS Number
503473-32-3
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
HIV; PKA; PKC; Src
Type
Reference compound
Related Pathways
Anti-infection; Epigenetics; Protein Tyrosine Kinase/RTK; Stem Cell/Wnt; TGF-beta/Smad
Applications
COVID-19-anti-virus
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/tx-1918.html
Smiles
O=C1/C(C(C=C1)=O)=C\C2=CC(C)=C(O)C(C)=C2
Molecular Formula
C14H12O3
Molecular Weight
228.24
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Hori H, et al., TX-1123: an antitumor 2-hydroxyarylidene-4-cyclopentene-1,3-dione as a protein tyrosine kinase inhibitor having low mitochondrial toxicity. Bioorg Med Chem. 2002 Oct;10 (10) :3257-65.|[2]Zhang DW, et al., A HTRF based competitive binding assay for screening specific inhibitors of HIV-1 capsid assembly targeting the C-Terminal domain of capsid. Antiviral Res. 2019 Sep;169:104544.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

2-((3,5-Dimethyl-4-hydroxyphenyl)-methylene)-4-cyclopentene-1,3-dione
CAS Number503473-32-3
PubChem CID6419746
IUPAC Name2-[(4-hydroxy-3,5-dimethylphenyl)methylidene]cyclopent-4-ene-1,3-dione
Molecular FormulaC14H12O3
Molecular Weight228.24
XLogP2.5
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity374
SMILES
CC1=CC(=CC(=C1O)C)C=C2C(=O)C=CC2=O
InChI
InChI=1S/C14H12O3/c1-8-5-10(6-9(2)14(8)17)7-11-12(15)3-4-13(11)16/h3-7,17H,1-2H3
InChIKey
YHWRISYBKMXSGJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((3,5-Dimethyl-4-hydroxyphenyl)-methylene)-4-cyclopentene-1,3-dione
CAS: 503473-32-3
CID: 6419746
Formula: C14H12O3
MW: 228.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight228.24
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass228.078644241
Monoisotopic Mass228.078644241
Topological Polar Surface Area54.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity374
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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